SCHEMBL30767712

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	4/20	0.58

▸	CTSL	P07711	3/20	0.58

▸	CTSS	P25774	3/20	0.58

▸	CTSK	P43235	3/20	0.58

▸	CTSH	P09668	1/20	0.58

▸	GLP1R	P43220	5/20	0.57

▸	CCKBR	P32239	2/20	0.57

▸	GCGR	P47871	2/20	0.56

▸	GIPR	P48546	2/20	0.56

▸	C5AR1	P21730	1/20	0.55

▸	NMBR	P28336	1/20	0.55

▸	GRPR	P30550	1/20	0.55

▸	KEAP1	Q14145	1/20	0.55

▸	CXCR4	P61073	1/20	0.54

▸	CALCR	P30988	2/20	0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
SCHEMBL30767709	0.97	GLP1R (0.61)	F2CTSLCTSSCTSKCTSH
SCHEMBL30767699	0.96	F2 (0.58)	F2CTSLCTSSCTSKCTSH
SCHEMBL30767696	0.93	GLP1R (0.60)	F2CTSLCTSSCTSKCTSH
SCHEMBL29461511	0.91	GLP1R (0.62)	F2GLP1RCCKBRGCGRGIPR
SCHEMBL30537029	0.90	GLP1R (0.72)	GLP1RCCKBRC5AR1CALCR
SCHEMBL30617830	0.87	C5AR1 (0.61)	F2CTSLCTSSCTSKCTSH
SCHEMBL31475675	0.87	CTSL (0.60)	CTSLCTSSCTSKCTSHCCKBR
SCHEMBL31073544	0.86	KISS1R (0.57)	F2GLP1RCCKBRGCGRGIPR
SCHEMBL31757090	0.86	C5AR1 (0.67)	F2CTSLCTSSCTSKCTSH
SCHEMBL30432200	0.86	NMBR (0.58)	CTSLCTSSCTSKCTSHGLP1R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-117327152-A	Digestion-resistant linear epitope peptide of penaeus vannamei allergen and application thereof	大连工业大学	2024-01-02	—	—	CN	disclosed